Vibration-rotation bands of acetylene and the molecular dimensions

Author:

Abstract

In view of recent inconsistencies in the relation between the bond lengths and rotational constants in the isotopic acetylenes, some vibration-rotation bands of acetylene have been re-measured, and the results have been analyzed together with earlier work on this molecule. The α values for each of the molecular vibrations have been re-determined, taking into account possible vibrational perturbations and also anomalous changes in the centrifugal stretching constant D of the different vibrational levels. The new values of α , 1 , α 2 , α 3 and ( α 4 + α 5 ) for acetylene are in line with the corresponding values for the deuterated derivatives, and using B o = 1·1766 lead to B e + 1·1817. If bond lengths r e (CH) = 1·058 5 , r e (CC) = l·204 7 Å are assumed, the results for all three isotopic molecules are mutually consistent. Values have also been obtained for the l -doubling coefficients, q 4 and q 5 .

Publisher

The Royal Society

Subject

Pharmacology (medical)

Reference16 articles.

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2. Vibration-rotation bands of deuterium cyanide

3. Z;Mecke R .;Phys.,1930

4. Herzberg G. 1945 Infra-red and Raman spectra. N ew York: van N ostrand.

5. �ber das Rotationsschwingungsspektrum des Acetylens (C2H2)

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